Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 2/20 | 0.39 |
| ▸ | MAOA | P21397 | 4/20 | 0.39 |
| ▸ | TYR | P14679 | 1/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | RAD51 | Q06609 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | BACE1 | P56817 | 3/20 | 0.38 |
| ▸ | APP | P05067 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | PTK6 | Q13882 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Ethoxycarbonyl Group SCHEMBL27768538 | 0.90 | TSHR (0.37) | CYP2A6MAOATYRUSP2GAA | |
| Ethoxycarbonyl Group SCHEMBL27768294 | 0.89 | MAPT (0.40) | CYP2A6MAOATYRUSP2GAA | |
| Ethoxycarbonyl Group SCHEMBL27768302 | 0.89 | CSNK2A1 (0.42) | CYP2A6MAOATYRUSP2GAA | |
| Ethoxycarbonyl Group SCHEMBL27597884 | 0.84 | GAA (0.62) | CYP2A6MAOATYRUSP2GAA | |
| Ethoxycarbonyl Group SCHEMBL27785495 | 0.84 | TYR (0.62) | CYP2A6MAOATYRUSP2GAA | |
| Ethoxycarbonyl Group SCHEMBL27648730 | 0.82 | CSNK2A1 (0.46) | CYP2A6MAOAGPR84MEN1POLB | |
| Ethoxycarbonyl Group SCHEMBL27526972 | 0.79 | CYP2A6 (0.46) | CYP2A6MAOATYRAPPMAPT | |
| Ethoxycarbonyl Group SCHEMBL27439208 | 0.79 | CYP2A6 (0.46) | CYP2A6MAOAUSP2GAAALOX15 | |
| SCHEMBL31375351 | 0.78 | TYR (0.58) | CYP2A6TYRUSP2GAAALOX15 | |
| SCHEMBL31375356 | 0.78 | TYR (0.58) | CYP2A6TYRUSP2GAAALOX15 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105073723-A | Compounds derived from protected or unprotected iridoids, compositions comprising same, use as dyes for keratin fibres and devices | OREAL | 2015-11-18 | — | — | CN | disclosed |